[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine

C13H15BrN2O — CID 105286828

IUPAC[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C13H15BrN2O/c1-8-5-9(2)7-10(6-8)13(16-15)11-3-4-12(14)17-11/h3-7,13,16H,15H2,1-2H3
InChIKeyCLDCMZZWVCKLPP-UHFFFAOYSA-N
MW295.18 g/mol
LogP3.21
Rot. Bonds3

About [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine

[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine (PubChem CID 105286828) has the molecular formula C13H15BrN2O and a molecular weight of 295.18 g/mol. Its IUPAC name is [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
PubChem CID105286828
Molecular FormulaC13H15BrN2O
Molecular Weight295.18 g/mol
Exact Mass294.04
IUPAC Name[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C13H15BrN2O/c1-8-5-9(2)7-10(6-8)13(16-15)11-3-4-12(14)17-11/h3-7,13,16H,15H2,1-2H3
InChIKeyCLDCMZZWVCKLPP-UHFFFAOYSA-N
XLogP3.21
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(3,5-dimethylphenyl)-(5-methylfuran-2-yl)methyl]hydrazine
CID 105286775
[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105305020
[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192528
[(2-bromo-4-methylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105286712
[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105287279
[(5-bromofuran-2-yl)-(4-phenylphenyl)methyl]hydrazine
CID 105310528
[(5-bromofuran-2-yl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288205
N-[(5-bromofuran-2-yl)-(3-chloro-5-methylphenyl)methyl]propan-1-amine
CID 81323088
[(5-bromofuran-2-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292488
[(3,5-dimethylphenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105338687
[(5-bromo-2-methylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105286710
(5-bromofuran-2-yl)-(3-chloro-5-methylphenyl)methanamine
CID 81322931

Frequently Asked Questions

What is the IUPAC name of [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine (CID 105286828) is [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine is Cc1cc(C)cc(C(NN)c2ccc(Br)o2)c1.
What is the InChIKey of [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The InChIKey is CLDCMZZWVCKLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O/c1-8-5-9(2)7-10(6-8)13(16-15)11-3-4-12(14)17-11/h3-7,13,16H,15H2,1-2H3.
What are the key properties of [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine has a molecular weight of 295.18 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 105286828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).